4-bromo-2-[2-(4-chloro-3-nitrophenyl)-6-(4-methylphenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]phenol
Chemical Structure Depiction of
4-bromo-2-[2-(4-chloro-3-nitrophenyl)-6-(4-methylphenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]phenol
4-bromo-2-[2-(4-chloro-3-nitrophenyl)-6-(4-methylphenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]phenol
Compound characteristics
| Compound ID: | K915-1516 |
| Compound Name: | 4-bromo-2-[2-(4-chloro-3-nitrophenyl)-6-(4-methylphenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]phenol |
| Molecular Weight: | 500.78 |
| Molecular Formula: | C23 H19 Br Cl N3 O3 |
| Smiles: | Cc1ccc(cc1)C1CC(c2cc(ccc2O)[Br])NC(c2ccc(c(c2)[N+]([O-])=O)[Cl])N=1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3341 |
| logD: | 6.3182 |
| logSw: | -5.9822 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.243 |
| InChI Key: | VQCNFYVWJGVIRN-UHFFFAOYSA-N |